Compound Identification
SMILES
CC1=NC(=CC=C1)N1C(=O)C(=CNNC(=O)C2=CC=CC=C2Cl)C2=CC=CC=C2C1=O
InChIKey
InChIKey=LRKWJEMDTUKYFL-UHFFFAOYSA-N
Formula
C23H17ClN4O3
Mass
432.86
Taxonomic Classification
Taxonomy Tree
-
Kingdom
Organic compounds
-
Superclass
Organoheterocyclic compounds
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Class
Isoquinolines and derivatives
- Subclass 1,3-isoquinolinediones
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Class
Isoquinolines and derivatives
-
Superclass
Organoheterocyclic compounds
Kingdom
Organic compounds
Superclass
Organoheterocyclic compounds
Class
Isoquinolines and derivatives
Subclass
1,3-isoquinolinediones
Intermediate Tree Nodes
Not available
Direct Parent
1,3-isoquinolinediones
Alternative Parents
Isoquinolones and derivatives Tetrahydroisoquinolines 2-halobenzoic acids and derivatives Benzoyl derivatives Methylpyridines Chlorobenzenes Aryl chlorides N-substituted carboxylic acid imides Imidolactams Vinylogous halides Vinylogous amides Heteroaromatic compounds Dicarboximides Carboxylic acid hydrazides Azacyclic compounds Organonitrogen compounds Carbonyl compounds Organic oxides Organochlorides Hydrocarbon derivatives
Molecular Framework
Aromatic heteropolycyclic compounds
Substituents
1,3-isoquinolinedione - Isoquinolone - Tetrahydroisoquinoline - 2-halobenzoic acid or derivatives - Halobenzoic acid or derivatives - Benzoic acid or derivatives - Benzoyl - Halobenzene - Chlorobenzene - Methylpyridine - Aryl chloride - Carboxylic acid imide, n-substituted - Pyridine - Aryl halide - Imidolactam - Monocyclic benzene moiety - Benzenoid - Vinylogous halide - Heteroaromatic compound - Dicarboximide - Vinylogous amide - Carboxylic acid imide - Carboxylic acid hydrazide - Azacycle - Carboxylic acid derivative - Organonitrogen compound - Carbonyl group - Organooxygen compound - Organic nitrogen compound - Hydrocarbon derivative - Organic oxide - Organic oxygen compound - Organochloride - Organohalogen compound - Aromatic heteropolycyclic compound
Description
This compound belongs to the class of organic compounds known as 1,3-isoquinolinediones. These are isoquinoline derivatives carrying one C=O group at positions 1, and 3 respectively.
External Descriptors
Not available